4350-44-1

Basic information

• Product Name: 2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER
• Synonyms: 2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER
• CAS NO: 4350-44-1
• Molecular Formula: C₁₆H₁₇NO₂
• Molecular Weight: 255.31168
• Mol File: 4350-44-1.mol
• Article Data: 14

Chemical Properties

• Boiling Point: 147 °C(Press: 1.5 Torr)
• Appearance: /
• Density: 1.086±0.06 g/cm3(Predicted)
• PKA: 4.89±0.18(Predicted)
• CAS DataBase Reference: 2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER(4350-44-1)
• EPA Substance Registry System: 2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER(4350-44-1)

Safety Data

• Hazardous Substances Data: 4350-44-1(Hazardous Substances Data)

Usage

Chemical compound

2,6-DIMETHYL-4-PHENYL-NICOTINIC ACID ETHYL ESTER

Class

Pyridine carboxylic acids

Derivative

Ethyl ester of nicotinic acid (Vitamin B3)

Molecular structure

Pyridine ring with two methyl groups at positions 2 and 6, phenyl group at position 4

Uses

Pharmaceutical research, building block for organic compound synthesis

Potential applications

Medicine, development of new drug candidates

Upstream product

• 23652-56-4 ethyl (Z/E)-β-acetylaminobut-2-enoate 
• 536-74-3 phenylacetylene 
• 626-34-6 ethyl aminocrotonate 
• 1896-62-4 (E)-benzalacetone 
• 626-34-6 ethyl 3-aminobut-2-enoate 
• 1817-57-8 4-phenyl-3-butyne-2-one 
• 141-97-9 ethyl acetoacetate 
• 61210-87-5 [((E)-4-phenylbut-3-en-2-ylidene)amino]hydroxide 
• 591-50-4 iodobenzene 
• 97308-46-8 ethyl 4-iodo-2,6-dimethyl-3-pyridinecarboxylate 

Downstream Products

• 1303445-84-2 N-[3,5-bis(trifluoromethyl)benzyl]-2,6-dimethyl-4-phenylnicotinamide 
• 1303445-86-4 N-[3,5-bis(trifluoromethyl)benzyl]-4-phenyl-N,2,6-trimethylnicotinamide 
• 401835-18-5 2,6-dimethyl-4-phenylnicotinic acid 
• 1338467-45-0 2-butyl-5-((2,6-dimethyl-4-phenylpyridin-3-ylmethyl)amino)isoindolin-1-one 
• 1338468-03-3 (2,6-dimethyl-4-phenylpyridin-3-yl)methyl methanesulfonate 
• 1338468-00-0 (2,6-dimethyl-4-phenylpyridin-3-yl)methanol 
• 1338467-33-6 2-butyl-5-((2,6-dimethyl-4-phenylpyridin-3-yl)methoxy)isoindolin-1-one 

Relevant articles and documents

Michael addition of ethyl acetoacetate to α,β-unsaturated oximes in the presence of FeCl3: A novel synthetic route to substituted nicotinic acid derivatives

The FeCl3-catalyzed reaction of α,β-unsaturated oximes with ethyl acetoacetate resulted in Michael addition followed by ring closure to produce substituted nicotinic acid derivatives in a very efficient way. (C) 2000 Elsevier Science Ltd.

Non-peptide NK1 receptor ligands based on the 4-phenylpyridine moiety

The quinoline nucleus of the previously described 4-phenylquinoline-3- carboxamides NK1 receptor ligands 7 has been transformed into either substituted or azole - (i.e., triazole or tetrazole) fused pyridine moieties of compounds 9 and 10, resp

One-pot multistep Bohlmann-Rahtz heteroannulation reactions: Synthesis of dimethyl sulfomycinamate

(Chemical Equation Presented) The synthesis of dimethyl sulfomycinamate, the acidic methanolysis product of the sulfomycin family of thiopeptide antibiotics, from methyl 2-oxo-4-(trimethylsilyl)but-3-ynoate is achieved in a 2,3,6-trisubstituted pyridine synthesis that proceeds with total regiocontrol in 13 steps by the Bohlmann-Rahtz heteroannulation of a 1-(oxazol-4-yl)enamine or in 12 steps and 9% yield by three-component cyclocondensation with N-[3-oxo-3-(oxazol-4-yl)propanoyl]serine and ammonia in ethanol.